(S)-1-Boc-piperidine-2-carboxylic acid

Base Information

• Chemical Name: (S)-1-Boc-piperidine-2-carboxylic acid
• CAS No.: 26250-84-0
• Molecular Formula: C11H19NO4
• Molecular Weight: 229.276
• Hs Code.: 29339900
• European Community (EC) Number: 628-510-4
• DSSTox Substance ID: DTXSID10350922
• Nikkaji Number: J732.361A
• Wikidata: Q72450448
• Mol file: 26250-84-0.mol

Synonyms:26250-84-0;Boc-Pip-OH;(S)-1-Boc-piperidine-2-carboxylic acid;Boc-L-Pipecolic acid;(s)-1-(tert-butoxycarbonyl)piperidine-2-carboxylic acid;(L)-N-Boc-Pipecolic acid;N-Boc-L-pipecolinic acid;(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid;(2s)-1-(tert-butoxycarbonyl)piperidine-2-carboxylic acid;(2S)-1-[(tert-butoxy)carbonyl]piperidine-2-carboxylic acid;Boc-(S)-(-)-piperidine-2-carboxylic acid;(S)-1-N-Boc-Pipecolinic acid;(S)-(-)-1-(tert-Butoxycarbonyl)-2-piperidinecarboxylic acid;(S)-PIPERIDINE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER;MFCD00151904;boc-l-pip-oh;(S)-N-BOC-2-PIPERIDINECARBOXYLIC ACID;boc-homopro-oh;BOC-HPro-OH;1-Boc-L-pipecolic Acid;Boc-Pip-OH, 98%;Oprea1_857311;SCHEMBL65490;BOC-BETA-HOMO-PRO-OH;N-BOC-L-PIPECOLIC ACID;(S)-1-(tert-Butoxycarbonyl)-2-piperidinecarboxylic Acid;DTXSID10350922;JQAOHGMPAAWWQO-QMMMGPOBSA-N;boc-l-piperidine-2-carboxylic acid;(S)-(-)-1-(tert-butoxycarbonyl)-2-piperidine carboxylic acid;STR08076;N-Boc-2(S)-piperidinecarboxylic acid;AKOS007930645;CS-W007743;HY-W007743;(S)-1-Boc-2-piperidinecarboxylic Acid;1-(tert-Butoxycarbonyl)-L-pipecolic Acid;AC-24077;TS-00596;(s)-1-n-boc-piperidine-2-carboxylic acid;AM20090324;B3700;(S)-(-)-1-Boc-2-piperidine carboxylic acid;EN300-71975;(2S)-N-(tert-Butyloxycarbonyl)pipecolinic acid;(2s)-piperidine-2-carboxylic acid, n-boc protected;N-(t-Butoxycarbonyl)piperidine-2(S)-carboxylic acid;Q-103009;(2S)-1-(tertbutoxycarbonyl)-2-piperidinecarboxylic acid;(2s)-1-(tertbutoxycarbonyl)piperidine-2-carboxylic acid;(S)-1-(tert-butoxycarbonyl)piperidine 2 carboxylic acid;(s)-n-tert-butyloxycarbonyl-piperidine-2-carboxylic acid;(S)-Piperidine-1,2-dicarboxylic acid Tert-butyl ester;1 -(t-Butyloxycarbonyl)-piperidine-2(S)-carboxylic acid;Z1033300648;(2S)-1-(tert butoxycarbonyl)-2-piperidinecarboxylic acid;(2S)-1-(tert-butoxycarbonyl)-2-piperidinecarboxylic acid;(2S)-Piperidine-1,2-dicarboxylic acid 1-tert-butyl ester;(S)-1-(tert-Butoxycarbonyl)-piperidine-2-carboxylic acid;(S)-Piperidine-1 pound not2-dicarboxylic acid 1-tert-butyl ester;(2S)-1-{[(1,1-dimethylethyl)oxy]carbonyl}-2-piperidinecarboxylic acid;(2S)-1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperidinecarboxylic acid

Chemical Property of (S)-1-Boc-piperidine-2-carboxylic acid

Chemical Property:

• Appearance/Colour: white to light yellow crystal powder
• Vapor Pressure: 6.15E-06mmHg at 25°C
• Melting Point: 122-126 °C(lit.)
• Refractive Index: 1.496
• Boiling Point: 353.2 °C at 760 mmHg
• PKA: 4.03±0.20(Predicted)
• Flash Point: 167.4 °C
• PSA: 66.84000
• Density: 1.164 g/cm³
• LogP: 1.79850
• Storage Temp.: Store at RT.
• Solubility.: Chloroform, Methanol
• Water Solubility.: Insoluble in water.
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 229.13140809
• Heavy Atom Count: 16
• Complexity: 282

Purity/Quality:

98%,99%, ^*data from raw suppliers

(S)-N-BocPipecolicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,Xn
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-22
• Safety Statements: 26-36-36/37/39-22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCCCC1C(=O)O
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)O
• Uses: (S)-1-Boc-piperidine-2-carboxylic acid is an N-substituted derivative of Pipecolinic acid useful in modulating ion channel activity. N-Boc-L-pipecolinic acid is a useful boc protected Pipecolic Acid for proteomics research in modulating ion channel activity.

Technology Process of (S)-1-Boc-piperidine-2-carboxylic acid

There total 45 articles about (S)-1-Boc-piperidine-2-carboxylic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

L-N-tert-butoxycarbonyl-4,5-dehydropipecolic acid → L-N-tert-butoxycarbonyl-4,5-dideutero-pipecolic acid + L-N-tert-butoxycarbonyl-pipecolic acid (26250-84-0,28697-17-8,98303-20-9,118552-55-9)

Guidance literature:

With palladium 10% on activated carbon; deuterium; In methanol;

DOI:10.1016/j.chembiol.2010.01.016

Reference yield: 98.0%

di-tert-butyl dicarbonate (24424-99-5) + pipecolinic acid (3105-95-1,83680-83-5) → (S)-(-)-1-(tert-butoxycarbonyl)-2-piperidinecarboxylic acid (26250-84-0)

Guidance literature:

With TEA; In methanol; a) 50 deg C, 5 min, b) RT, 1 h;

DOI:10.1021/jm970620j

Reference yield: 98.0%

(S)-2-((S)-1,2-Dihydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester (417726-34-2) → (S)-(-)-1-(tert-butoxycarbonyl)-2-piperidinecarboxylic acid (26250-84-0)

Guidance literature:

With potassium permanganate; sodium periodate; sodium carbonate; In 1,4-dioxane; water;

DOI:10.1016/S0040-4039(01)02271-7

upstream raw materials:

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

pipecolic Acid

tert-butyl (2S)-2-(hydroxymethyl)piperidine-1-carboxylate

(2R)-2-t-butoxycarbonylamino-3-phenylsulfonyl-1-(2-tetrahydropyranyloxy)propane

Downstream raw materials:

tert-butyl (2S)-2-{[methoxy(methyl)amino]-carbonyl}piperidine-1-carboxylate

(S)-2-(2-hydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester

2-[({[(benzyloxycarbonylmethyl-carbamoyl)-methyl]-carbamoyl}-methyl)-carbamoyl]-piperidine-1-carboxylic acid tert-butyl ester

(S)-tert-butyl 2-((R)-1-((2R,4R)-2-(3-azidopropyl)-4-(naphthalen-2-ylmethoxy)pyrrolidin-1-yl)-1-oxo-3-phenylpropan-2-ylcarbamoyl)piperidine-1-carboxylate

Refernces

• 1、 Zhu, Mei,Zhou, Huiyu,Ma, Ling,Dong, Biao,Zhou, Jinming,Zhang, Guoning,Wang, Minghua,Wang, Juxian,Cen, Shan,Wang, Yucheng. "Design and evaluation of novel piperidine HIV-1 protease inhibitors with potency against DRV-resistant variants". . . Retrieved 2021/06/02.
• 2、 -. "MORPHINAN DERIVATIVE". Paragraph 0113-0114; 0117-0118. . Retrieved 2019/06/27.